N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine

C7H11ClN4O2S — CID 84761064

IUPACN'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine
SMILESNCCNS(=O)(=O)Nc1cccc(Cl)n1
InChIInChI=1S/C7H11ClN4O2S/c8-6-2-1-3-7(11-6)12-15(13,14)10-5-4-9/h1-3,10H,4-5,9H2,(H,11,12)
InChIKeyOVFFLESPYAXXCC-UHFFFAOYSA-N
MW250.71 g/mol
LogP-0.06
Rot. Bonds5

About N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine

N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine (PubChem CID 84761064) has the molecular formula C7H11ClN4O2S and a molecular weight of 250.71 g/mol. Its IUPAC name is N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine
PubChem CID84761064
Molecular FormulaC7H11ClN4O2S
Molecular Weight250.71 g/mol
Exact Mass250.03
IUPAC NameN'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine
SMILESNCCNS(=O)(=O)Nc1cccc(Cl)n1
InChIInChI=1S/C7H11ClN4O2S/c8-6-2-1-3-7(11-6)12-15(13,14)10-5-4-9/h1-3,10H,4-5,9H2,(H,11,12)
InChIKeyOVFFLESPYAXXCC-UHFFFAOYSA-N
XLogP-0.06
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.71
LogP ≤ 5-0.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2,3-dichloro-N-(6-chloro-2-pyridinyl)benzenesulfonamide
CID 113456961
N-(6-chloro-2-pyridinyl)-1-phenylmethanesulfonamide
CID 113456958
N'-(6-chloro-2-pyridinyl)butane-1,4-diamine
CID 117097392
N-(6-chloro-2-pyridinyl)-2,5-difluorobenzenesulfonamide
CID 104821362
N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide
CID 104821271
N-(6-chloro-2-pyridinyl)-4-methoxybenzenesulfonamide
CID 113456951
N-(6-chloro-2-pyridinyl)-2,5-dimethylthiophene-3-sulfonamide
CID 104821321
N-(6-chloro-2-pyridinyl)-2,3,5,6-tetramethylbenzenesulfonamide
CID 104821325
N'-[(2-ethylphenyl)sulfamoyl]ethane-1,2-diamine
CID 84760891
N-(2-aminoethyl)-1-(3,4-dichlorophenyl)methanesulfonamide;hydrochloride
CID 86780512
6-chloro-N-fluoropyridin-2-amine
CID 171556919
N-(6-chloro-2-pyridinyl)-5-fluoro-2-methylbenzenesulfonamide
CID 113456965

Frequently Asked Questions

What is the IUPAC name of N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine?
The IUPAC name of N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine (CID 84761064) is N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine.
What is the SMILES notation for N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine?
The canonical SMILES for N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine is NCCNS(=O)(=O)Nc1cccc(Cl)n1.
What is the InChIKey of N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine?
The InChIKey is OVFFLESPYAXXCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11ClN4O2S/c8-6-2-1-3-7(11-6)12-15(13,14)10-5-4-9/h1-3,10H,4-5,9H2,(H,11,12).
What are the key properties of N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine?
N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine has a molecular weight of 250.71 g/mol, XLogP of -0.06, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(6-chloro-2-pyridinyl)sulfamoyl]ethane-1,2-diamine is sourced from PubChem (CID 84761064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).